carbamimidoylazanium; 4-(4-sulfonatobutyldisulfanyl)butane-1-sulfonate

Systemtic Name: carbamimidoylazanium; 4-(4-sulfonatobutyldisulfanyl)butane-1-sulfonate Openeye Name: carbamimidoylammonium; 4-(4-sulfonatobutyldisulfanyl)butane-1-sulfonate CAS Name: carbamimidoylammonium; 4-(4-sulfonatobutyldisulfanyl)-1-butanesulfonate IUPAC Name: carbamimidoylazanium; 4-(4-sulfonatobutyldisulfanyl)butane-1-sulfonate Traditional Name: amidinoammonium; 4-(4-sulfonatobutyldisulfanyl)butane-1-sulfonate Formula: C10H28N6O6S4 MolecularWeight: 456.62592

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Descriptors Computed from Structure

Canonical SMILES:

C(CCS(=O)(=O)[O-])CSSCCCCS(=O)(=O)[O-].C(=N)([NH3+])N.C(=N)([NH3+])N

Isomeric SMILES

C(CCS(=O)(=O)[O-])CSSCCCCS(=O)(=O)[O-].C(=N)([NH3+])N.C(=N)([NH3+])N

InChI

InChI=1S/C8H18O6S4.2CH5N3/c9-17(10,11)7-3-1-5-15-16-6-2-4-8-18(12,13)14;2*2-1(3)4/h1-8H2,(H,9,10,11)(H,12,13,14);2*(H5,2,3,4)